6-[[4-[ethyl(1H-indazol-4-yl)amino]-5-fluoranyl-pyrimidin-2-yl]amino]-4H-1,4-benzoxazin-3-one

Systemtic Name: 6-[[4-[ethyl(1H-indazol-4-yl)amino]-5-fluoranyl-pyrimidin-2-yl]amino]-4H-1,4-benzoxazin-3-one Openeye Name: 6-[[4-[ethyl(1H-indazol-4-yl)amino]-5-fluoro-pyrimidin-2-yl]amino]-4H-1,4-benzoxazin-3-one CAS Name: 6-[[4-[ethyl(1H-indazol-4-yl)amino]-5-fluoro-2-pyrimidinyl]amino]-4H-1,4-benzoxazin-3-one IUPAC Name: 6-[[4-[ethyl(1H-indazol-4-yl)amino]-5-fluoropyrimidin-2-yl]amino]-4H-1,4-benzoxazin-3-one Traditional Name: 6-[[4-[ethyl(1H-indazol-4-yl)amino]-5-fluoro-pyrimidin-2-yl]amino]-4H-1,4-benzoxazin-3-one Formula: C21H18FN7O2 MolecularWeight: 419.411723

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1=CC=CC2=C1C=NN2)C3=NC(=NC=C3F)NC4=CC5=C(C=C4)OCC(=O)N5

Isomeric SMILES

CCN(C1=CC=CC2=C1C=NN2)C3=NC(=NC=C3F)NC4=CC5=C(C=C4)OCC(=O)N5

InChI

InChI=1S/C21H18FN7O2/c1-2-29(17-5-3-4-15-13(17)9-24-28-15)20-14(22)10-23-21(27-20)25-12-6-7-18-16(8-12)26-19(30)11-31-18/h3-10H,2,11H2,1H3,(H,24,28)(H,26,30)(H,23,25,27)